[3-[[2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-cyano-4-(trifluoromethylsulfinyl)pyrazol-3-yl]carbamoyloxy]-2-(phenylcarbonyloxy)propyl] benzoate

Systemtic Name: [3-[[2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-cyano-4-(trifluoromethylsulfinyl)pyrazol-3-yl]carbamoyloxy]-2-(phenylcarbonyloxy)propyl] benzoate Openeye Name: [2-benzoyloxy-3-[[5-cyano-2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazol-3-yl]carbamoyloxy]propyl] benzoate CAS Name: benzoic acid [2-benzoyloxy-3-[[[5-cyano-2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)-3-pyrazolyl]amino]-oxomethoxy]propyl] ester IUPAC Name: [2-benzoyloxy-3-[[5-cyano-2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazol-3-yl]carbamoyloxy]propyl] benzoate Traditional Name: benzoic acid [2-benzoyloxy-3-[[5-cyano-2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfinyl)pyrazol-3-yl]carbamoyloxy]propyl] ester Formula: C30H18Cl2F6N4O7S MolecularWeight: 763.447939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(COC(=O)NC2=C(C(=NN2C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)C#N)S(=O)C(F)(F)F)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC(COC(=O)NC2=C(C(=NN2C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)C#N)S(=O)C(F)(F)F)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H18Cl2F6N4O7S/c31-20-11-18(29(33,34)35)12-21(32)23(20)42-25(24(22(13-39)41-42)50(46)30(36,37)38)40-28(45)48-15-19(49-27(44)17-9-5-2-6-10-17)14-47-26(43)16-7-3-1-4-8-16/h1-12,19H,14-15H2,(H,40,45)